ethyl (E)-5-[1-(benzotriazol-1-yl)butyl-(phenylmethyl)amino]-4-methyl-pent-2-enoate

Systemtic Name: ethyl (E)-5-[1-(benzotriazol-1-yl)butyl-(phenylmethyl)amino]-4-methyl-pent-2-enoate Openeye Name: ethyl (E)-5-[1-(benzotriazol-1-yl)butyl-benzyl-amino]-4-methyl-pent-2-enoate CAS Name: (E)-5-[1-(1-benzotriazolyl)butyl-(phenylmethyl)amino]-4-methyl-2-pentenoic acid ethyl ester IUPAC Name: ethyl (E)-5-[1-(benzotriazol-1-yl)butyl-benzylamino]-4-methylpent-2-enoate Traditional Name: (E)-5-[1-(benzotriazol-1-yl)butyl-benzyl-amino]-4-methyl-pent-2-enoic acid ethyl ester Formula: C25H32N4O2 MolecularWeight: 420.54718

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(N1C2=CC=CC=C2N=N1)N(CC3=CC=CC=C3)CC(C)C=CC(=O)OCC

Isomeric SMILES

CCCC(N1C2=CC=CC=C2N=N1)N(CC3=CC=CC=C3)CC(C)/C=C/C(=O)OCC

InChI

InChI=1S/C25H32N4O2/c1-4-11-24(29-23-15-10-9-14-22(23)26-27-29)28(19-21-12-7-6-8-13-21)18-20(3)16-17-25(30)31-5-2/h6-10,12-17,20,24H,4-5,11,18-19H2,1-3H3/b17-16+