(2S)-5-(aminocarbonylamino)-2-[(4,7-dimethoxy-1H-indol-2-yl)carbonylamino]pentanoate

Systemtic Name: (2S)-5-(aminocarbonylamino)-2-[(4,7-dimethoxy-1H-indol-2-yl)carbonylamino]pentanoate Openeye Name: (2S)-2-[(4,7-dimethoxy-1H-indole-2-carbonyl)amino]-5-ureido-pentanoate CAS Name: (2S)-5-(carbamoylamino)-2-[[(4,7-dimethoxy-1H-indol-2-yl)-oxomethyl]amino]pentanoate IUPAC Name: (2S)-5-(carbamoylamino)-2-[(4,7-dimethoxy-1H-indole-2-carbonyl)amino]pentanoate Traditional Name: (2S)-2-[(4,7-dimethoxy-1H-indole-2-carbonyl)amino]-5-ureido-valerate Formula: C17H21N4O6- MolecularWeight: 377.37184

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C=C(NC2=C(C=C1)OC)C(=O)NC(CCCNC(=O)N)C(=O)[O-]

Isomeric SMILES

COC1=C2C=C(NC2=C(C=C1)OC)C(=O)N[C@@H](CCCNC(=O)N)C(=O)[O-]

InChI

InChI=1S/C17H22N4O6/c1-26-12-5-6-13(27-2)14-9(12)8-11(20-14)15(22)21-10(16(23)24)4-3-7-19-17(18)25/h5-6,8,10,20H,3-4,7H2,1-2H3,(H,21,22)(H,23,24)(H3,18,19,25)/p-1/t10-/m0/s1