2-[1-tert-butyl-7-[(4-carbamimidoylphenyl)carbamoyl]-1,2,3,4-tetrahydronaphthalen-2-yl]ethanoic acid

Systemtic Name: 2-[1-tert-butyl-7-[(4-carbamimidoylphenyl)carbamoyl]-1,2,3,4-tetrahydronaphthalen-2-yl]ethanoic acid Openeye Name: 2-[1-tert-butyl-7-[(4-carbamimidoylphenyl)carbamoyl]tetralin-2-yl]acetic acid CAS Name: 2-[1-tert-butyl-7-[(4-carbamimidoylanilino)-oxomethyl]-1,2,3,4-tetrahydronaphthalen-2-yl]acetic acid IUPAC Name: 2-[1-tert-butyl-7-[(4-carbamimidoylphenyl)carbamoyl]-1,2,3,4-tetrahydronaphthalen-2-yl]acetic acid Traditional Name: 2-[7-[(4-amidinophenyl)carbamoyl]-1-tert-butyl-tetralin-2-yl]acetic acid Formula: C24H29N3O3 MolecularWeight: 407.50536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1C(CCC2=C1C=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=N)N)CC(=O)O

Isomeric SMILES

CC(C)(C)C1C(CCC2=C1C=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=N)N)CC(=O)O

InChI

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