tert-butyl N-[(3-azanyl-2-oxidanyl-4-phenyl-butyl)-[[4-(diethylamino)phenyl]methyl]amino]carbamate

Systemtic Name: tert-butyl N-[(3-azanyl-2-oxidanyl-4-phenyl-butyl)-[[4-(diethylamino)phenyl]methyl]amino]carbamate Openeye Name: tert-butyl N-[(3-amino-2-hydroxy-4-phenyl-butyl)-[[4-(diethylamino)phenyl]methyl]amino]carbamate CAS Name: N-[(3-amino-2-hydroxy-4-phenylbutyl)-[[4-(diethylamino)phenyl]methyl]amino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(3-amino-2-hydroxy-4-phenylbutyl)-[[4-(diethylamino)phenyl]methyl]amino]carbamate Traditional Name: N-[(3-amino-2-hydroxy-4-phenyl-butyl)-[4-(diethylamino)benzyl]amino]carbamic acid tert-butyl ester Formula: C26H40N4O3 MolecularWeight: 456.6208

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)CN(CC(C(CC2=CC=CC=C2)N)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)CN(CC(C(CC2=CC=CC=C2)N)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C26H40N4O3/c1-6-29(7-2)22-15-13-21(14-16-22)18-30(28-25(32)33-26(3,4)5)19-24(31)23(27)17-20-11-9-8-10-12-20/h8-16,23-24,31H,6-7,17-19,27H2,1-5H3,(H,28,32)