tert-butyl N-[4-[(7-bromanyl-3-nitro-quinolin-4-yl)amino]butyl]carbamate

Systemtic Name: tert-butyl N-[4-[(7-bromanyl-3-nitro-quinolin-4-yl)amino]butyl]carbamate Openeye Name: tert-butyl N-[4-[(7-bromo-3-nitro-4-quinolyl)amino]butyl]carbamate CAS Name: N-[4-[(7-bromo-3-nitro-4-quinolinyl)amino]butyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[(7-bromo-3-nitroquinolin-4-yl)amino]butyl]carbamate Traditional Name: N-[4-[(7-bromo-3-nitro-4-quinolyl)amino]butyl]carbamic acid tert-butyl ester Formula: C18H23BrN4O4 MolecularWeight: 439.30362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCCNC1=C2C=CC(=CC2=NC=C1[N+](=O)[O-])Br

Isomeric SMILES

CC(C)(C)OC(=O)NCCCCNC1=C2C=CC(=CC2=NC=C1[N+](=O)[O-])Br

InChI

InChI=1S/C18H23BrN4O4/c1-18(2,3)27-17(24)21-9-5-4-8-20-16-13-7-6-12(19)10-14(13)22-11-15(16)23(25)26/h6-7,10-11H,4-5,8-9H2,1-3H3,(H,20,22)(H,21,24)