1-[2-[(6-carbamimidoyl-1-ethyl-indol-3-yl)methyl]phenyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[(6-carbamimidoyl-1-ethyl-indol-3-yl)methyl]phenyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[(6-carbamimidoyl-1-ethyl-indol-3-yl)methyl]phenyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[(6-carbamimidoyl-1-ethyl-3-indolyl)methyl]phenyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[(6-carbamimidoyl-1-ethylindol-3-yl)methyl]phenyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[(6-amidino-1-ethyl-indol-3-yl)methyl]phenyl]proline Formula: C23H26N4O2 MolecularWeight: 390.47814

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=C1C=C(C=C2)C(=N)N)CC3=CC=CC=C3N4CCCC4C(=O)O

Isomeric SMILES

CCN1C=C(C2=C1C=C(C=C2)C(=N)N)CC3=CC=CC=C3N4CCCC4C(=O)O

InChI

InChI=1S/C23H26N4O2/c1-2-26-14-17(18-10-9-16(22(24)25)13-21(18)26)12-15-6-3-4-7-19(15)27-11-5-8-20(27)23(28)29/h3-4,6-7,9-10,13-14,20H,2,5,8,11-12H2,1H3,(H3,24,25)(H,28,29)