2-[2-[(6-carbamimidoyl-1-ethyl-indol-3-yl)methyl]-5-(propylcarbamoyl)phenyl]-5-methoxy-benzoic acid

Systemtic Name: 2-[2-[(6-carbamimidoyl-1-ethyl-indol-3-yl)methyl]-5-(propylcarbamoyl)phenyl]-5-methoxy-benzoic acid Openeye Name: 2-[2-[(6-carbamimidoyl-1-ethyl-indol-3-yl)methyl]-5-(propylcarbamoyl)phenyl]-5-methoxy-benzoic acid CAS Name: 2-[2-[(6-carbamimidoyl-1-ethyl-3-indolyl)methyl]-5-[oxo(propylamino)methyl]phenyl]-5-methoxybenzoic acid IUPAC Name: 2-[2-[(6-carbamimidoyl-1-ethylindol-3-yl)methyl]-5-(propylcarbamoyl)phenyl]-5-methoxybenzoic acid Traditional Name: 2-[2-[(6-amidino-1-ethyl-indol-3-yl)methyl]-5-(propylcarbamoyl)phenyl]-5-methoxy-benzoic acid Formula: C30H32N4O4 MolecularWeight: 512.59948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC(=C(C=C1)CC2=CN(C3=C2C=CC(=C3)C(=N)N)CC)C4=C(C=C(C=C4)OC)C(=O)O

Isomeric SMILES

CCCNC(=O)C1=CC(=C(C=C1)CC2=CN(C3=C2C=CC(=C3)C(=N)N)CC)C4=C(C=C(C=C4)OC)C(=O)O

InChI

InChI=1S/C30H32N4O4/c1-4-12-33-29(35)20-7-6-18(25(14-20)24-11-9-22(38-3)16-26(24)30(36)37)13-21-17-34(5-2)27-15-19(28(31)32)8-10-23(21)27/h6-11,14-17H,4-5,12-13H2,1-3H3,(H3,31,32)(H,33,35)(H,36,37)