2-azanyl-4-(3-bromanyl-4,5-dimethoxy-phenyl)-7-(cyclopropylmethyl)-4H-pyrano[2,3-e]indole-3-carbonitrile

Systemtic Name: 2-azanyl-4-(3-bromanyl-4,5-dimethoxy-phenyl)-7-(cyclopropylmethyl)-4H-pyrano[2,3-e]indole-3-carbonitrile Openeye Name: 2-amino-4-(3-bromo-4,5-dimethoxy-phenyl)-7-(cyclopropylmethyl)-4H-pyrano[2,3-e]indole-3-carbonitrile CAS Name: 2-amino-4-(3-bromo-4,5-dimethoxyphenyl)-7-(cyclopropylmethyl)-4H-pyrano[2,3-e]indole-3-carbonitrile IUPAC Name: 2-amino-4-(3-bromo-4,5-dimethoxyphenyl)-7-(cyclopropylmethyl)-4H-pyrano[2,3-e]indole-3-carbonitrile Traditional Name: 2-amino-4-(3-bromo-4,5-dimethoxy-phenyl)-7-(cyclopropylmethyl)-4H-pyran[2,3-e]indole-3-carbonitrile Formula: C24H22BrN3O3 MolecularWeight: 480.35378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2C3=C(C4=C(C=C3)N(C=C4)CC5CC5)OC(=C2C#N)N)Br)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C2C3=C(C4=C(C=C3)N(C=C4)CC5CC5)OC(=C2C#N)N)Br)OC

InChI

InChI=1S/C24H22BrN3O3/c1-29-20-10-14(9-18(25)23(20)30-2)21-16-5-6-19-15(7-8-28(19)12-13-3-4-13)22(16)31-24(27)17(21)11-26/h5-10,13,21H,3-4,12,27H2,1-2H3