methyl 4-[2-[(5-carbamimidoyl-1H-indol-2-yl)carbonylamino]ethanoylamino]butanoate

Systemtic Name: methyl 4-[2-[(5-carbamimidoyl-1H-indol-2-yl)carbonylamino]ethanoylamino]butanoate Openeye Name: methyl 4-[[2-[(5-carbamimidoyl-1H-indole-2-carbonyl)amino]acetyl]amino]butanoate CAS Name: 4-[[2-[[(5-carbamimidoyl-1H-indol-2-yl)-oxomethyl]amino]-1-oxoethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[2-[(5-carbamimidoyl-1H-indole-2-carbonyl)amino]acetyl]amino]butanoate Traditional Name: 4-[[2-[(5-amidino-1H-indole-2-carbonyl)amino]acetyl]amino]butyric acid methyl ester Formula: C17H21N5O4 MolecularWeight: 359.37974

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC(=O)CNC(=O)C1=CC2=C(N1)C=CC(=C2)C(=N)N

Isomeric SMILES

COC(=O)CCCNC(=O)CNC(=O)C1=CC2=C(N1)C=CC(=C2)C(=N)N

InChI

InChI=1S/C17H21N5O4/c1-26-15(24)3-2-6-20-14(23)9-21-17(25)13-8-11-7-10(16(18)19)4-5-12(11)22-13/h4-5,7-8,22H,2-3,6,9H2,1H3,(H3,18,19)(H,20,23)(H,21,25)