2-[6-carbamimidoyl-2-[2-(4-pyrrolidin-3-yloxyphenyl)ethyl]indol-1-yl]ethanoic acid

Systemtic Name: 2-[6-carbamimidoyl-2-[2-(4-pyrrolidin-3-yloxyphenyl)ethyl]indol-1-yl]ethanoic acid Openeye Name: 2-[6-carbamimidoyl-2-[2-(4-pyrrolidin-3-yloxyphenyl)ethyl]indol-1-yl]acetic acid CAS Name: 2-[6-carbamimidoyl-2-[2-[4-(3-pyrrolidinyloxy)phenyl]ethyl]-1-indolyl]acetic acid IUPAC Name: 2-[6-carbamimidoyl-2-[2-(4-pyrrolidin-3-yloxyphenyl)ethyl]indol-1-yl]acetic acid Traditional Name: 2-[6-amidino-2-[2-(4-pyrrolidin-3-yloxyphenyl)ethyl]indol-1-yl]acetic acid Formula: C23H26N4O3 MolecularWeight: 406.47754

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC1OC2=CC=C(C=C2)CCC3=CC4=C(N3CC(=O)O)C=C(C=C4)C(=N)N

Isomeric SMILES

C1CNCC1OC2=CC=C(C=C2)CCC3=CC4=C(N3CC(=O)O)C=C(C=C4)C(=N)N

InChI

InChI=1S/C23H26N4O3/c24-23(25)17-5-4-16-11-18(27(14-22(28)29)21(16)12-17)6-1-15-2-7-19(8-3-15)30-20-9-10-26-13-20/h2-5,7-8,11-12,20,26H,1,6,9-10,13-14H2,(H3,24,25)(H,28,29)