[4-(2-azanyl-3-cyano-7-methyl-4H-pyrano[2,3-e]indol-4-yl)-2-bromanyl-6-methoxy-phenyl] ethanoate

Systemtic Name: [4-(2-azanyl-3-cyano-7-methyl-4H-pyrano[2,3-e]indol-4-yl)-2-bromanyl-6-methoxy-phenyl] ethanoate Openeye Name: [4-(2-amino-3-cyano-7-methyl-4H-pyrano[2,3-e]indol-4-yl)-2-bromo-6-methoxy-phenyl] acetate CAS Name: acetic acid [4-(2-amino-3-cyano-7-methyl-4H-pyrano[2,3-e]indol-4-yl)-2-bromo-6-methoxyphenyl] ester IUPAC Name: [4-(2-amino-3-cyano-7-methyl-4H-pyrano[2,3-e]indol-4-yl)-2-bromo-6-methoxyphenyl] acetate Traditional Name: acetic acid [4-(2-amino-3-cyano-7-methyl-4H-pyran[2,3-e]indol-4-yl)-2-bromo-6-methoxy-phenyl] ester Formula: C22H18BrN3O4 MolecularWeight: 468.30002

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1Br)C2C3=C(C4=C(C=C3)N(C=C4)C)OC(=C2C#N)N)OC

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1Br)C2C3=C(C4=C(C=C3)N(C=C4)C)OC(=C2C#N)N)OC

InChI

InChI=1S/C22H18BrN3O4/c1-11(27)29-21-16(23)8-12(9-18(21)28-3)19-14-4-5-17-13(6-7-26(17)2)20(14)30-22(25)15(19)10-24/h4-9,19H,25H2,1-3H3