7-[(5-carbamimidoyl-3-methyl-1H-indol-2-yl)carbonylamino]heptanoic acid

Systemtic Name: 7-[(5-carbamimidoyl-3-methyl-1H-indol-2-yl)carbonylamino]heptanoic acid Openeye Name: 7-[(5-carbamimidoyl-3-methyl-1H-indole-2-carbonyl)amino]heptanoic acid CAS Name: 7-[[(5-carbamimidoyl-3-methyl-1H-indol-2-yl)-oxomethyl]amino]heptanoic acid IUPAC Name: 7-[(5-carbamimidoyl-3-methyl-1H-indole-2-carbonyl)amino]heptanoic acid Traditional Name: 7-[(5-amidino-3-methyl-1H-indole-2-carbonyl)amino]enanthic acid Formula: C18H24N4O3 MolecularWeight: 344.40816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C=C(C=C2)C(=N)N)C(=O)NCCCCCCC(=O)O

Isomeric SMILES

CC1=C(NC2=C1C=C(C=C2)C(=N)N)C(=O)NCCCCCCC(=O)O

InChI

InChI=1S/C18H24N4O3/c1-11-13-10-12(17(19)20)7-8-14(13)22-16(11)18(25)21-9-5-3-2-4-6-15(23)24/h7-8,10,22H,2-6,9H2,1H3,(H3,19,20)(H,21,25)(H,23,24)