methyl 4-(2-azanyl-3-cyano-5-ethanoyl-4H-pyrano[3,2-b]indol-4-yl)benzoate

Systemtic Name: methyl 4-(2-azanyl-3-cyano-5-ethanoyl-4H-pyrano[3,2-b]indol-4-yl)benzoate Openeye Name: methyl 4-(5-acetyl-2-amino-3-cyano-4H-pyrano[3,2-b]indol-4-yl)benzoate CAS Name: 4-(5-acetyl-2-amino-3-cyano-4H-pyrano[3,2-b]indol-4-yl)benzoic acid methyl ester IUPAC Name: methyl 4-(5-acetyl-2-amino-3-cyano-4H-pyrano[3,2-b]indol-4-yl)benzoate Traditional Name: 4-(5-acetyl-2-amino-3-cyano-4H-pyran[3,2-b]indol-4-yl)benzoic acid methyl ester Formula: C22H17N3O4 MolecularWeight: 387.38808

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C2=CC=CC=C2C3=C1C(C(=C(O3)N)C#N)C4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC(=O)N1C2=CC=CC=C2C3=C1C(C(=C(O3)N)C#N)C4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C22H17N3O4/c1-12(26)25-17-6-4-3-5-15(17)20-19(25)18(16(11-23)21(24)29-20)13-7-9-14(10-8-13)22(27)28-2/h3-10,18H,24H2,1-2H3