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2-chloranyl-3-oxidanylidene-5-phenyl-4-[(phenylmethyl)amino]pentanal

2-chloranyl-3-oxidanylidene-5-phenyl-4-[(phenylmethyl)amino]pentanal

Systemtic Name:2-chloranyl-3-oxidanylidene-5-phenyl-4-[(phenylmethyl)amino]pentanal
Openeye Name:4-(benzylamino)-2-chloro-3-oxo-5-phenyl-pentanal
CAS Name:2-chloro-3-oxo-5-phenyl-4-[(phenylmethyl)amino]pentanal
IUPAC Name:4-(benzylamino)-2-chloro-3-oxo-5-phenylpentanal
Traditional Name:4-(benzylamino)-2-chloro-3-keto-5-phenyl-valeraldehyde
Formula: C18H18ClNO2
MolecularWeight: 315.79402
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)C(C=O)Cl)NCC2=CC=CC=C2


Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)C(C=O)Cl)NCC2=CC=CC=C2


InChI

InChI=1S/C18H18ClNO2/c19-16(13-21)18(22)17(11-14-7-3-1-4-8-14)20-12-15-9-5-2-6-10-15/h1-10,13,16-17,20H,11-12H2


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