2-ethoxy-4-[(4R,7R)-2-methyl-5-oxidanylidene-3-propan-2-yloxycarbonyl-7-thiophen-2-yl-4a,6,7,8-tetrahydro-4H-quinolin-4-yl]-6-nitro-phenolate

Systemtic Name: 2-ethoxy-4-[(4R,7R)-2-methyl-5-oxidanylidene-3-propan-2-yloxycarbonyl-7-thiophen-2-yl-4a,6,7,8-tetrahydro-4H-quinolin-4-yl]-6-nitro-phenolate Openeye Name: 2-ethoxy-4-[(4R,7R)-3-isopropoxycarbonyl-2-methyl-5-oxo-7-(2-thienyl)-4a,6,7,8-tetrahydro-4H-quinolin-4-yl]-6-nitro-phenolate CAS Name: 2-ethoxy-4-[(4R,7R)-2-methyl-5-oxo-3-[oxo(propan-2-yloxy)methyl]-7-thiophen-2-yl-4a,6,7,8-tetrahydro-4H-quinolin-4-yl]-6-nitrophenolate IUPAC Name: 2-ethoxy-4-[(4R,7R)-2-methyl-5-oxo-3-propan-2-yloxycarbonyl-7-thiophen-2-yl-4a,6,7,8-tetrahydro-4H-quinolin-4-yl]-6-nitrophenolate Traditional Name: 2-ethoxy-4-[(4R,7R)-3-isopropoxycarbonyl-5-keto-2-methyl-7-(2-thienyl)-4a,6,7,8-tetrahydro-4H-quinolin-4-yl]-6-nitro-phenolate Formula: C26H27N2O7S- MolecularWeight: 511.56678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1[O-])[N+](=O)[O-])C2C3C(=NC(=C2C(=O)OC(C)C)C)CC(CC3=O)C4=CC=CS4

Isomeric SMILES

CCOC1=CC(=CC(=C1[O-])[N+](=O)[O-])[C@H]2C3C(=NC(=C2C(=O)OC(C)C)C)C[C@H](CC3=O)C4=CC=CS4

InChI

InChI=1S/C26H28N2O7S/c1-5-34-20-12-16(10-18(25(20)30)28(32)33)23-22(26(31)35-13(2)3)14(4)27-17-9-15(11-19(29)24(17)23)21-7-6-8-36-21/h6-8,10,12-13,15,23-24,30H,5,9,11H2,1-4H3/p-1/t15-,23-,24?/m1/s1