2-azanyl-N-cyclopropyl-N-(6-oxidanyl-4-oxidanylidene-2-phenethyl-2-propyl-3H-pyran-5-yl)benzamide; quinoline-8-sulfonic acid

Systemtic Name: 2-azanyl-N-cyclopropyl-N-(6-oxidanyl-4-oxidanylidene-2-phenethyl-2-propyl-3H-pyran-5-yl)benzamide; quinoline-8-sulfonic acid Openeye Name: 2-amino-N-cyclopropyl-N-(6-hydroxy-4-oxo-2-phenethyl-2-propyl-3H-pyran-5-yl)benzamide; quinoline-8-sulfonic acid CAS Name: 2-amino-N-cyclopropyl-N-(6-hydroxy-4-oxo-2-phenethyl-2-propyl-3H-pyran-5-yl)benzamide; 8-quinolinesulfonic acid IUPAC Name: 2-amino-N-cyclopropyl-N-(6-hydroxy-4-oxo-2-phenethyl-2-propyl-3H-pyran-5-yl)benzamide; quinoline-8-sulfonic acid Traditional Name: 2-amino-N-cyclopropyl-N-(6-hydroxy-4-keto-2-phenethyl-2-propyl-3H-pyran-5-yl)benzamide; quinoline-8-sulfonic acid Formula: C35H37N3O7S MolecularWeight: 643.74918

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CC(=O)C(=C(O1)O)N(C2CC2)C(=O)C3=CC=CC=C3N)CCC4=CC=CC=C4.C1=CC2=C(C(=C1)S(=O)(=O)O)N=CC=C2

Isomeric SMILES

CCCC1(CC(=O)C(=C(O1)O)N(C2CC2)C(=O)C3=CC=CC=C3N)CCC4=CC=CC=C4.C1=CC2=C(C(=C1)S(=O)(=O)O)N=CC=C2

InChI

InChI=1S/C26H30N2O4.C9H7NO3S/c1-2-15-26(16-14-18-8-4-3-5-9-18)17-22(29)23(25(31)32-26)28(19-12-13-19)24(30)20-10-6-7-11-21(20)27;11-14(12,13)8-5-1-3-7-4-2-6-10-9(7)8/h3-11,19,31H,2,12-17,27H2,1H3;1-6H,(H,11,12,13)