2-chloranyl-4-hexadecoxy-5-(3-methylheptan-3-yl)aniline

Systemtic Name: 2-chloranyl-4-hexadecoxy-5-(3-methylheptan-3-yl)aniline Openeye Name: 2-chloro-5-(1-ethyl-1-methyl-pentyl)-4-hexadecoxy-aniline CAS Name: 2-chloro-4-hexadecoxy-5-(3-methylheptan-3-yl)aniline IUPAC Name: 2-chloro-4-hexadecoxy-5-(3-methylheptan-3-yl)aniline Traditional Name: [4-cetyloxy-2-chloro-5-(1-ethyl-1-methyl-pentyl)phenyl]amine Formula: C30H54ClNO MolecularWeight: 480.20886

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=CC(=C(C=C1C(C)(CC)CCCC)N)Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=CC(=C(C=C1C(C)(CC)CCCC)N)Cl

InChI

InChI=1S/C30H54ClNO/c1-5-8-10-11-12-13-14-15-16-17-18-19-20-21-23-33-29-25-27(31)28(32)24-26(29)30(4,7-3)22-9-6-2/h24-25H,5-23,32H2,1-4H3