1-[2-[bis(2-chloroethyl)amino]-5-formamido-phenyl]indole-2-carboxylic acid

Systemtic Name: 1-[2-[bis(2-chloroethyl)amino]-5-formamido-phenyl]indole-2-carboxylic acid Openeye Name: 1-[2-[bis(2-chloroethyl)amino]-5-formamido-phenyl]indole-2-carboxylic acid CAS Name: 1-[2-[bis(2-chloroethyl)amino]-5-formamidophenyl]-2-indolecarboxylic acid IUPAC Name: 1-[2-[bis(2-chloroethyl)amino]-5-formamidophenyl]indole-2-carboxylic acid Traditional Name: 1-[2-[bis(2-chloroethyl)amino]-5-formamido-phenyl]indole-2-carboxylic acid Formula: C20H19Cl2N3O3 MolecularWeight: 420.28916

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(N2C3=C(C=CC(=C3)NC=O)N(CCCl)CCCl)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(N2C3=C(C=CC(=C3)NC=O)N(CCCl)CCCl)C(=O)O

InChI

InChI=1S/C20H19Cl2N3O3/c21-7-9-24(10-8-22)17-6-5-15(23-13-26)12-18(17)25-16-4-2-1-3-14(16)11-19(25)20(27)28/h1-6,11-13H,7-10H2,(H,23,26)(H,27,28)