2-[1-butan-2-yl-7-[(4-carbamimidoylphenyl)carbonylamino]-1,2,3,4-tetrahydronaphthalen-2-yl]ethanoate

Systemtic Name: 2-[1-butan-2-yl-7-[(4-carbamimidoylphenyl)carbonylamino]-1,2,3,4-tetrahydronaphthalen-2-yl]ethanoate Openeye Name: 2-[7-[(4-carbamimidoylbenzoyl)amino]-1-sec-butyl-tetralin-2-yl]acetate CAS Name: 2-[1-butan-2-yl-7-[[(4-carbamimidoylphenyl)-oxomethyl]amino]-1,2,3,4-tetrahydronaphthalen-2-yl]acetate IUPAC Name: 2-[1-butan-2-yl-7-[(4-carbamimidoylbenzoyl)amino]-1,2,3,4-tetrahydronaphthalen-2-yl]acetate Traditional Name: 2-[7-[(4-amidinobenzoyl)amino]-1-sec-butyl-tetralin-2-yl]acetate Formula: C24H28N3O3- MolecularWeight: 406.49742

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1C(CCC2=C1C=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=N)N)CC(=O)[O-]

Isomeric SMILES

CCC(C)C1C(CCC2=C1C=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=N)N)CC(=O)[O-]

InChI

InChI=1S/C24H29N3O3/c1-3-14(2)22-18(12-21(28)29)9-4-15-10-11-19(13-20(15)22)27-24(30)17-7-5-16(6-8-17)23(25)26/h5-8,10-11,13-14,18,22H,3-4,9,12H2,1-2H3,(H3,25,26)(H,27,30)(H,28,29)/p-1