3-[(3-aminophenyl)methyl]-2-(5-methyl-2-oxidanyl-phenyl)-1H-indole-5-carboximidamide

Systemtic Name: 3-[(3-aminophenyl)methyl]-2-(5-methyl-2-oxidanyl-phenyl)-1H-indole-5-carboximidamide Openeye Name: 3-[(3-aminophenyl)methyl]-2-(2-hydroxy-5-methyl-phenyl)-1H-indole-5-carboxamidine CAS Name: 3-[(3-aminophenyl)methyl]-2-(2-hydroxy-5-methylphenyl)-1H-indole-5-carboximidamide IUPAC Name: 3-[(3-aminophenyl)methyl]-2-(2-hydroxy-5-methylphenyl)-1H-indole-5-carboximidamide Traditional Name: 3-(3-aminobenzyl)-2-(2-hydroxy-5-methyl-phenyl)-1H-indole-5-carboxamidine Formula: C23H22N4O MolecularWeight: 370.44698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)C2=C(C3=C(N2)C=CC(=C3)C(=N)N)CC4=CC(=CC=C4)N

Isomeric SMILES

CC1=CC(=C(C=C1)O)C2=C(C3=C(N2)C=CC(=C3)C(=N)N)CC4=CC(=CC=C4)N

InChI

InChI=1S/C23H22N4O/c1-13-5-8-21(28)19(9-13)22-18(11-14-3-2-4-16(24)10-14)17-12-15(23(25)26)6-7-20(17)27-22/h2-10,12,27-28H,11,24H2,1H3,(H3,25,26)