ethyl 3-[4-[[(5-carbamimidoyl-1H-indol-2-yl)carbonylamino]methyl]phenyl]propanoate

Systemtic Name: ethyl 3-[4-[[(5-carbamimidoyl-1H-indol-2-yl)carbonylamino]methyl]phenyl]propanoate Openeye Name: ethyl 3-[4-[[(5-carbamimidoyl-1H-indole-2-carbonyl)amino]methyl]phenyl]propanoate CAS Name: 3-[4-[[[(5-carbamimidoyl-1H-indol-2-yl)-oxomethyl]amino]methyl]phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[4-[[(5-carbamimidoyl-1H-indole-2-carbonyl)amino]methyl]phenyl]propanoate Traditional Name: 3-[4-[[(5-amidino-1H-indole-2-carbonyl)amino]methyl]phenyl]propionic acid ethyl ester Formula: C22H24N4O3 MolecularWeight: 392.45096

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=CC=C(C=C1)CNC(=O)C2=CC3=C(N2)C=CC(=C3)C(=N)N

Isomeric SMILES

CCOC(=O)CCC1=CC=C(C=C1)CNC(=O)C2=CC3=C(N2)C=CC(=C3)C(=N)N

InChI

InChI=1S/C22H24N4O3/c1-2-29-20(27)10-7-14-3-5-15(6-4-14)13-25-22(28)19-12-17-11-16(21(23)24)8-9-18(17)26-19/h3-6,8-9,11-12,26H,2,7,10,13H2,1H3,(H3,23,24)(H,25,28)