[(E,1S)-7-[(2-aminophenyl)amino]-1-(5-bromanyl-2-oxidanyl-phenyl)-7-oxidanylidene-hept-5-enyl] N-naphthalen-1-ylcarbamate

Systemtic Name: [(E,1S)-7-[(2-aminophenyl)amino]-1-(5-bromanyl-2-oxidanyl-phenyl)-7-oxidanylidene-hept-5-enyl] N-naphthalen-1-ylcarbamate Openeye Name: [(E,1S)-7-(2-aminoanilino)-1-(5-bromo-2-hydroxy-phenyl)-7-oxo-hept-5-enyl] N-(1-naphthyl)carbamate CAS Name: N-(1-naphthalenyl)carbamic acid [(E,1S)-7-(2-aminoanilino)-1-(5-bromo-2-hydroxyphenyl)-7-oxohept-5-enyl] ester IUPAC Name: [(E,1S)-7-(2-aminoanilino)-1-(5-bromo-2-hydroxyphenyl)-7-oxohept-5-enyl] N-naphthalen-1-ylcarbamate Traditional Name: N-(1-naphthyl)carbamic acid [(E,1S)-7-(2-aminoanilino)-1-(5-bromo-2-hydroxy-phenyl)-7-keto-hept-5-enyl] ester Formula: C30H28BrN3O4 MolecularWeight: 574.46502

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2NC(=O)OC(CCCC=CC(=O)NC3=CC=CC=C3N)C4=C(C=CC(=C4)Br)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2NC(=O)O[C@@H](CCC/C=C/C(=O)NC3=CC=CC=C3N)C4=C(C=CC(=C4)Br)O

InChI

InChI=1S/C30H28BrN3O4/c31-21-17-18-27(35)23(19-21)28(15-2-1-3-16-29(36)33-26-13-7-6-12-24(26)32)38-30(37)34-25-14-8-10-20-9-4-5-11-22(20)25/h3-14,16-19,28,35H,1-2,15,32H2,(H,33,36)(H,34,37)/b16-3+/t28-/m0/s1