N-[5-azanyl-2-(2-chloroethyl)cyclohexa-1,5-dien-1-yl]-5,6,7-trimethoxy-1H-indole-2-carboxamide

Systemtic Name: N-[5-azanyl-2-(2-chloroethyl)cyclohexa-1,5-dien-1-yl]-5,6,7-trimethoxy-1H-indole-2-carboxamide Openeye Name: N-[5-amino-2-(2-chloroethyl)cyclohexa-1,5-dien-1-yl]-5,6,7-trimethoxy-1H-indole-2-carboxamide CAS Name: N-[5-amino-2-(2-chloroethyl)-1-cyclohexa-1,5-dienyl]-5,6,7-trimethoxy-1H-indole-2-carboxamide IUPAC Name: N-[5-amino-2-(2-chloroethyl)cyclohexa-1,5-dien-1-yl]-5,6,7-trimethoxy-1H-indole-2-carboxamide Traditional Name: N-[5-amino-2-(2-chloroethyl)cyclohexa-1,5-dien-1-yl]-5,6,7-trimethoxy-1H-indole-2-carboxamide Formula: C20H24ClN3O4 MolecularWeight: 405.87526

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C(=C1)C=C(N2)C(=O)NC3=C(CCC(=C3)N)CCCl)OC)OC

Isomeric SMILES

COC1=C(C(=C2C(=C1)C=C(N2)C(=O)NC3=C(CCC(=C3)N)CCCl)OC)OC

InChI

InChI=1S/C20H24ClN3O4/c1-26-16-9-12-8-15(23-17(12)19(28-3)18(16)27-2)20(25)24-14-10-13(22)5-4-11(14)6-7-21/h8-10,23H,4-7,22H2,1-3H3,(H,24,25)