3-chloranyl-4-methyl-N-[(2S)-2-phenylpropyl]aniline

Systemtic Name: 3-chloranyl-4-methyl-N-[(2S)-2-phenylpropyl]aniline Openeye Name: 3-chloro-4-methyl-N-[(2S)-2-phenylpropyl]aniline CAS Name: 3-chloro-4-methyl-N-[(2S)-2-phenylpropyl]aniline IUPAC Name: 3-chloro-4-methyl-N-[(2S)-2-phenylpropyl]aniline Traditional Name: (3-chloro-4-methyl-phenyl)-[(2S)-2-phenylpropyl]amine Formula: C16H18ClN MolecularWeight: 259.77382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NCC(C)C2=CC=CC=C2)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC[C@@H](C)C2=CC=CC=C2)Cl

InChI

InChI=1S/C16H18ClN/c1-12-8-9-15(10-16(12)17)18-11-13(2)14-6-4-3-5-7-14/h3-10,13,18H,11H2,1-2H3/t13-/m1/s1