[4-[(3-bromophenyl)amino]-3-cyano-1,4,4a,8a-tetrahydroquinolin-8-yl] carbamate

Systemtic Name: [4-[(3-bromophenyl)amino]-3-cyano-1,4,4a,8a-tetrahydroquinolin-8-yl] carbamate Openeye Name: [4-(3-bromoanilino)-3-cyano-1,4,4a,8a-tetrahydroquinolin-8-yl] carbamate CAS Name: carbamic acid [4-(3-bromoanilino)-3-cyano-1,4,4a,8a-tetrahydroquinolin-8-yl] ester IUPAC Name: [4-(3-bromoanilino)-3-cyano-1,4,4a,8a-tetrahydroquinolin-8-yl] carbamate Traditional Name: carbamic acid [4-(3-bromoanilino)-3-cyano-1,4,4a,8a-tetrahydroquinolin-8-yl] ester Formula: C17H15BrN4O2 MolecularWeight: 387.2306

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2C(C(=C1)OC(=O)N)NC=C(C2NC3=CC(=CC=C3)Br)C#N

Isomeric SMILES

C1=CC2C(C(=C1)OC(=O)N)NC=C(C2NC3=CC(=CC=C3)Br)C#N

InChI

InChI=1S/C17H15BrN4O2/c18-11-3-1-4-12(7-11)22-15-10(8-19)9-21-16-13(15)5-2-6-14(16)24-17(20)23/h1-7,9,13,15-16,21-22H,(H2,20,23)