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2-methyl-N-[(E)-octadec-9-enyl]aziridin-1-amine; (E)-undec-2-enoic acid

2-methyl-N-[(E)-octadec-9-enyl]aziridin-1-amine; (E)-undec-2-enoic acid

Systemtic Name:2-methyl-N-[(E)-octadec-9-enyl]aziridin-1-amine; (E)-undec-2-enoic acid
Openeye Name:2-methyl-N-[(E)-octadec-9-enyl]aziridin-1-amine; (E)-undec-2-enoic acid
CAS Name:2-methyl-N-[(E)-octadec-9-enyl]-1-aziridinamine; (E)-2-undecenoic acid
IUPAC Name:2-methyl-N-[(E)-octadec-9-enyl]aziridin-1-amine; (E)-undec-2-enoic acid
Traditional Name:(2-methylethylenimin-1-yl)-[(E)-octadec-9-enyl]amine; (E)-undec-2-enoic acid
Formula: C43H82N2O4
MolecularWeight: 691.12218
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCNN1CC1C.CCCCCCCCC=CC(=O)O.CCCCCCCCC=CC(=O)O


Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCNN1C(C1)C.CCCCCCCC/C=C/C(=O)O.CCCCCCCC/C=C/C(=O)O


InChI

InChI=1S/C21H42N2.2C11H20O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-23-20-21(23)2;2*1-2-3-4-5-6-7-8-9-10-11(12)13/h10-11,21-22H,3-9,12-20H2,1-2H3;2*9-10H,2-8H2,1H3,(H,12,13)/b11-10+;2*10-9+


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