tert-butyl 2-[aminocarbonyl-(4-bromophenyl)amino]-4-[(4-methoxy-4-oxidanylidene-butyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)amino]butanoate

Systemtic Name: tert-butyl 2-[aminocarbonyl-(4-bromophenyl)amino]-4-[(4-methoxy-4-oxidanylidene-butyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)amino]butanoate Openeye Name: tert-butyl 2-(4-bromo-N-carbamoyl-anilino)-4-[(4-methoxy-4-oxo-butyl)-tetralin-1-yl-amino]butanoate CAS Name: 2-(4-bromo-N-carbamoylanilino)-4-[(4-methoxy-4-oxobutyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)amino]butanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-(4-bromo-N-carbamoylanilino)-4-[(4-methoxy-4-oxobutyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)amino]butanoate Traditional Name: 2-(4-bromo-N-carbamoyl-anilino)-4-[(4-keto-4-methoxy-butyl)-tetralin-1-yl-amino]butyric acid tert-butyl ester Formula: C30H40BrN3O5 MolecularWeight: 602.5597

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CCN(CCCC(=O)OC)C1CCCC2=CC=CC=C12)N(C3=CC=C(C=C3)Br)C(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)C(CCN(CCCC(=O)OC)C1CCCC2=CC=CC=C12)N(C3=CC=C(C=C3)Br)C(=O)N

InChI

InChI=1S/C30H40BrN3O5/c1-30(2,3)39-28(36)26(34(29(32)37)23-16-14-22(31)15-17-23)18-20-33(19-8-13-27(35)38-4)25-12-7-10-21-9-5-6-11-24(21)25/h5-6,9,11,14-17,25-26H,7-8,10,12-13,18-20H2,1-4H3,(H2,32,37)